(5-nitro-2-pyrrolidin-1-yl-phenyl)-piperidin-1-yl-methanone

Systemtic Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-piperidin-1-yl-methanone Openeye Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-(1-piperidyl)methanone CAS Name: [5-nitro-2-(1-pyrrolidinyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: (5-nitro-2-pyrrolidin-1-ylphenyl)-piperidin-1-ylmethanone Traditional Name: (5-nitro-2-pyrrolidino-phenyl)-piperidino-methanone Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C16H21N3O3/c20-16(18-10-2-1-3-11-18)14-12-13(19(21)22)6-7-15(14)17-8-4-5-9-17/h6-7,12H,1-5,8-11H2